N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-1-(m-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-1-[(3-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-1-(3-methylbenzyl)sulfonyl-isonipecotamide Formula: C26H35N3O6S2 MolecularWeight: 549.7026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H35N3O6S2/c1-20-7-6-8-21(17-20)19-36(31,32)28-15-11-22(12-16-28)26(30)27-23-9-10-24(35-2)25(18-23)37(33,34)29-13-4-3-5-14-29/h6-10,17-18,22H,3-5,11-16,19H2,1-2H3,(H,27,30)